SCHEMBL7048368

SCHEMBL7048368

Cc1cc(Br)cc(C)c1OC(=O)c1c2ccccc2nc2ccccc12

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
NQO2 P16083 1/20 0.44
PDE10A Q9Y233 2/20 0.43
MAPT P10636 5/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KDM4E B2RXH2 5/20 0.41
POLB P06746 4/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 1/20 0.41
TSHR P16473 1/20 0.40
TP53 P04637 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
DHODH Q02127 1/20 0.39
GLA P06280 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7047710 0.86 MAPT (0.45) MEN1KMT2APDE10AMAPTNPSR1
SCHEMBL38663293 0.86 NCOR2 (0.45) MEN1KMT2AMAPTNPSR1ALDH1A1
SCHEMBL38661829 0.85 MEN1 (0.49) MEN1KMT2APDE10AMAPTNPSR1
SCHEMBL1054774 0.85 MEN1 (0.49) MEN1KMT2APDE10AMAPTNPSR1
SCHEMBL7050086 0.85 MEN1 (0.44) MEN1KMT2APDE10AMAPTNPSR1
SCHEMBL3092289 0.84 MEN1 (0.52) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL38665523 0.83 PKM (0.43) MEN1KMT2APDE10AMAPTNPSR1
SCHEMBL7047790 0.82 MAPT (0.55) MEN1KMT2AMAPTKDM4EPOLB
SCHEMBL15413120 0.82 KMT2A (0.48) MEN1KMT2AMAPTNPSR1KDM4E
SCHEMBL7050018 0.80 MAPT (0.46) MEN1KMT2APDE10AMAPTNPSR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0609885-B1 Acridinium compounds and conjugates thereof MOCHIDA PHARM CO LTD (JP) 2003-04-16 EP disclosed
US-5594112-A CHEMILUMINESCENCE LABEL MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1997-01-14 US disclosed
US-5438139-A Chemiluminescent; useful as immunolochemical, DNA probe and receptor bininding assays MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-08-01 US disclosed
EP-0609885-A1 Acridinium compounds and conjugates thereof MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1994-08-10 EP disclosed